3-[(2,4,6-trinitrophenyl)amino]propan-1-ol

Systemtic Name: 3-[(2,4,6-trinitrophenyl)amino]propan-1-ol Openeye Name: 3-(2,4,6-trinitroanilino)propan-1-ol CAS Name: 3-(2,4,6-trinitroanilino)-1-propanol IUPAC Name: 3-(2,4,6-trinitroanilino)propan-1-ol Traditional Name: 3-(2,4,6-trinitroanilino)propan-1-ol Formula: C9H10N4O7 MolecularWeight: 286.1983

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])NCCCO)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])NCCCO)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H10N4O7/c14-3-1-2-10-9-7(12(17)18)4-6(11(15)16)5-8(9)13(19)20/h4-5,10,14H,1-3H2